Vitas-M small molecule compound
7',7'-dimethyl-2'-(methylsulfanyl)-5'-oxo-5',6',7',8'-tetrahydro-1'H-spiro[cyclohexane-1,4'-quinoline]-3'-carbonitrile
Catalog ID
STK834177
SMILES CSC1=C(C#N)C2(C3=C(N1)CC(C)(C)CC3=O)CCCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H24N2OS MW 316.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2OS/c1-17(2)9-13-15(14(21)10-17)18(7-5-4-6-8-18)12(11-19)16(20-13)22-3/h20H,4-10H2,1-3H3InChIKey
SKEMNRUBYYAFRX-UHFFFAOYSA-NSynonyms
211613-58-0211613580
77dimethyl2(methylsulfanyl)5oxo5678tetrahydro1Hspiro(cyclohexane14quinoline)3carbonitrile
77dimethyl2(methylthio)5oxo5678tetrahydro1Hspiro(cyclohexane14quinoline)3carbonitrile
77DIMETHYL2METHYLSULFANYL5OXOSPIRO(68DIHYDRO1HQUINOLINE41CYCLOHEXANE)3CARBONITRILE
CC1(CC2=C(C(=O)C1)C3(CCCCC3)C(=C(N2)SC)C#N)C
InChI=1SC18H24N2OSc117(2)91315(14(21)1017)18(7546818)12(1119)16(2013)223h20H410H213H3
ZINC000018006193
ZINC103521688
ZINC18006193
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